N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide

C13H15N5O3 — CID 63101953

IUPACN-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)c1[nH]ncc1N
InChIInChI=1S/C13H15N5O3/c1-7(19)16-8-3-4-11(21-2)10(5-8)17-13(20)12-9(14)6-15-18-12/h3-6H,14H2,1-2H3,(H,15,18)(H,16,19)(H,17,20)
InChIKeyYBQHNEXMMLCFJW-UHFFFAOYSA-N
MW289.30 g/mol
LogP1.21
Rot. Bonds4

About N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide

N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide (PubChem CID 63101953) has the molecular formula C13H15N5O3 and a molecular weight of 289.30 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide
PubChem CID63101953
Molecular FormulaC13H15N5O3
Molecular Weight289.30 g/mol
Exact Mass289.12
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)c1[nH]ncc1N
InChIInChI=1S/C13H15N5O3/c1-7(19)16-8-3-4-11(21-2)10(5-8)17-13(20)12-9(14)6-15-18-12/h3-6H,14H2,1-2H3,(H,15,18)(H,16,19)(H,17,20)
InChIKeyYBQHNEXMMLCFJW-UHFFFAOYSA-N
XLogP1.21
TPSA122.13 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.30
LogP ≤ 51.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-methoxy-3-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]acetamide
CID 43715781
N-(3,4-dimethoxyphenyl)-4-methyl-1H-pyrazole-5-carboxamide
CID 110860648
4-amino-N-[4-(difluoromethoxy)-3-fluorophenyl]-1H-pyrazole-5-carboxamide
CID 63101769
N-(5-acetamido-2-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 17417372
propan-2-yl 5-[(5-acetamido-2-methoxyphenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
CID 36554284
4-amino-N-(4-fluoro-2-iodophenyl)-1H-pyrazole-5-carboxamide
CID 79768952
4-amino-N-(2-ethoxyphenyl)-1H-pyrazole-5-carboxamide
CID 63105944
N-(5-acetamido-2-methoxyphenyl)-6-methoxypyrimidine-4-carboxamide
CID 121167268
N-(5-acetamido-2-methoxyphenyl)-1,3-thiazole-4-carboxamide
CID 62047199
N-(5-acetamido-2-methoxyphenyl)-3-chloropropanamide
CID 43236542
4-amino-N-(4-methylsulfanylphenyl)-1H-pyrazole-5-carboxamide
CID 63106114
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
CID 119266368

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide (CID 63101953) is N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide is COc1ccc(NC(C)=O)cc1NC(=O)c1[nH]ncc1N.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide?
The InChIKey is YBQHNEXMMLCFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O3/c1-7(19)16-8-3-4-11(21-2)10(5-8)17-13(20)12-9(14)6-15-18-12/h3-6H,14H2,1-2H3,(H,15,18)(H,16,19)(H,17,20).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide?
N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide has a molecular weight of 289.30 g/mol, XLogP of 1.21, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-4-amino-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 63101953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).